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Inhibitor Report for: Diphenylurea

IC50: 93 nM human-EPHX2


General
Type Urea derivative
Chemical_Nomenclature 1,3-diphenylurea
Canonical SMILES C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2
InChI InChI=1S/C13H12N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)
InChIKey GWEHVDNNLFDJLR-UHFFFAOYSA-N
Other name(s) BSU ; 1,3-Diphenylurea ; N,N'-Diphenylurea ; CARBANILIDE ; Diphenylcarbamide ; CHEBI:41320 ; CHEMBL354676
________________________________________________________________________________________________
MW|212.24
Formula|C13H12N2O
CAS_number|102-07-8
PubChem|7595
UniChem|GWEHVDNNLFDJLR-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Diphenylurea ligand of proteins in family: Epoxide_hydrolase
Stucture | 3 structures: 5CW2, 5AI5, 2ZJF
Protein | myctu-ephB, myct3-g7cf24, human-EPHX2

References:
Search PubMed for references concerning: Diphenylurea

1 more
    Title: The crystal structure of mycobacterial epoxide hydrolase A
    Schulz EC, Henderson SR, Illarionov B, Crosskey T, Southall SM, Krichel B, Uetrecht C, Fischer M, Wilmanns M
    Ref: Sci Rep, 10:16539, 2020 : PubMed

            

    Title: Successful generation of structural information for fragment-based drug discovery
    Oster L, Tapani S, Xue Y, Kack H
    Ref: Drug Discov Today, 20:1104, 2015 : PubMed

            

    Title: The molecular structure of epoxide hydrolase B from Mycobacterium tuberculosis and its complex with a urea-based inhibitor
    Biswal BK, Morisseau C, Garen G, Cherney MM, Garen C, Niu C, Hammock BD, James MN
    Ref: Journal of Molecular Biology, 381:897, 2008 : PubMed